(2R,3S)-4-[(4-nitrophenyl)amino]-2,3-bis(oxidanyl)-4-oxidanylidene-butanoate

Systemtic Name: (2R,3S)-4-[(4-nitrophenyl)amino]-2,3-bis(oxidanyl)-4-oxidanylidene-butanoate Openeye Name: (2R,3S)-2,3-dihydroxy-4-(4-nitroanilino)-4-oxo-butanoate CAS Name: (2R,3S)-2,3-dihydroxy-4-(4-nitroanilino)-4-oxobutanoate IUPAC Name: (2R,3S)-2,3-dihydroxy-4-(4-nitroanilino)-4-oxobutanoate Traditional Name: (2R,3S)-2,3-dihydroxy-4-keto-4-(4-nitroanilino)butyrate Formula: C10H9N2O7- MolecularWeight: 269.18766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C(C(C(=O)[O-])O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)[C@H]([C@H](C(=O)[O-])O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H10N2O7/c13-7(8(14)10(16)17)9(15)11-5-1-3-6(4-2-5)12(18)19/h1-4,7-8,13-14H,(H,11,15)(H,16,17)/p-1/t7-,8+/m0/s1